![TRICORNOSE_A;3-O-[(E)-3,4,5-TRIMETHOXYCINNAMOYL]-BETA-D-FRUCTOFURANOSYL-(2->1)-(6-O-ACETYL)-ALPHA-D-GLUCOPYRANOSIDE](/api/spectrum/5EZokVgL9M8/structure.png?h=300&w=458 "TRICORNOSE_A;3-O-[(E)-3,4,5-TRIMETHOXYCINNAMOYL]-BETA-D-FRUCTOFURANOSYL-(2->1)-(6-O-ACETYL)-ALPHA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | 9sZekD8YiPu |
|---|---|
| InChI | InChI=1S/C26H36O16/c1-12(29)38-10-17-19(31)21(33)22(34)25(39-17)42-26(11-28)24(20(32)16(9-27)41-26)40-18(30)6-5-13-7-14(35-2)23(37-4)15(8-13)36-3/h5-8,16-17,19-22,24-25,27-28,31-34H,9-11H2,1-4H3/b6-5+/t16-,17+,19+,20-,21-,22+,24+,25+,26+/m1/s1 |
| InChIKey | AQHOVWARMAUWCZ-ZJCAZUFWSA-N |
| Mol Weight | 604.6 g/mol |
| Molecular Formula | C26H36O16 |
| Exact Mass | 604.200335 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5EZokVgL9M8 |
|---|---|
| Name | TRICORNOSE_A;3-O-[(E)-3,4,5-TRIMETHOXYCINNAMOYL]-BETA-D-FRUCTOFURANOSYL-(2->1)-(6-O-ACETYL)-ALPHA-D-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H36O16 |
| InChI | InChI=1S/C26H36O16/c1-12(29)38-10-17-19(31)21(33)22(34)25(39-17)42-26(11-28)24(20(32)16(9-27)41-26)40-18(30)6-5-13-7-14(35-2)23(37-4)15(8-13)36-3/h5-8,16-17,19-22,24-25,27-28,31-34H,9-11H2,1-4H3/b6-5+/t16-,17+,19+,20-,21-,22+,24+,25+,26+/m1/s1 |
| InChIKey | AQHOVWARMAUWCZ-ZJCAZUFWSA-N |
| Literature Reference Author | J.LI,Y.JIANG,P.F.TU |
| Literature Reference Citation | J.NAT.PROD.,68,739(2005) |
| Literature Reference DOI | 10.1021/np050023x |
| Molecular Weight | 604.562 g/mol |
| Solvent | CD3OD |